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Information card for entry 7048128
Preview
Coordinates | 7048128.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H17 Br2 N9 O7 Re2 |
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Calculated formula | C22 H17 Br2 N9 O7 Re2 |
Title of publication | Multiple coordination modes of a new ditopic bis(pyrazolyl)methane-based ligand. |
Authors of publication | Coulton, John B.; Smith, Aramis C.; Wheeler, Kraig A.; Semeniuc, Radu F. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2018 |
Journal volume | 47 |
Journal issue | 47 |
Pages of publication | 17109 - 17121 |
a | 10.4206 ± 0.0004 Å |
b | 13.4302 ± 0.0005 Å |
c | 13.6824 ± 0.0006 Å |
α | 63.05 ± 0.002° |
β | 78.311 ± 0.002° |
γ | 71.078 ± 0.002° |
Cell volume | 1611.15 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0226 |
Residual factor for significantly intense reflections | 0.0218 |
Weighted residual factors for significantly intense reflections | 0.0523 |
Weighted residual factors for all reflections included in the refinement | 0.0527 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.117 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7048128.html
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